SpectraBase Spectrum ID |
LwMaGS3xhfK |
Name |
7-Methyl-3-phenyl-2H-1,4-benzoxazine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
223.099714042 u |
Formula |
C15H13NO |
InChI |
InChI=1S/C15H13NO/c1-11-7-8-13-15(9-11)17-10-14(16-13)12-5-3-2-4-6-12/h2-9H,10H2,1H3 |
InChIKey |
OFLJHPRUKCTETP-UHFFFAOYSA-N |
Molecular Weight |
223.275 g/mol |
SMILES |
C1OC=2C(N=C1C=1C=CC=CC1)=CC=C(C2)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910044 |